2-[(4-carboxyphenyl)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid

Systemtic Name: 2-[(4-carboxyphenyl)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Openeye Name: 2-[(4-carboxyphenyl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid CAS Name: 2-[(4-carboxyphenyl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid IUPAC Name: 2-[(4-carboxyphenyl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Traditional Name: 2-(4-carboxybenzyl)-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Formula: C22H19NO5 MolecularWeight: 377.38996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)C(=O)O)O)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CC=C(C=C4)C(=O)O)O)C(=O)O

InChI

InChI=1S/C22H19NO5/c24-20-17(11-12-5-7-14(8-6-12)21(25)26)23-19-15-4-2-1-3-13(15)9-10-16(19)18(20)22(27)28/h5-10,24H,1-4,11H2,(H,25,26)(H,27,28)